(4-methylsulfonyl-1,4-diazepan-1-yl)-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-[1-(2-naphthylsulfonyl)-4-piperidyl]methanone CAS Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-[1-(2-naphthalenylsulfonyl)-4-piperidinyl]methanone IUPAC Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: (4-mesyl-1,4-diazepan-1-yl)-[1-(2-naphthylsulfonyl)-4-piperidyl]methanone Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H29N3O5S2/c1-31(27,28)24-12-4-11-23(15-16-24)22(26)19-9-13-25(14-10-19)32(29,30)21-8-7-18-5-2-3-6-20(18)17-21/h2-3,5-8,17,19H,4,9-16H2,1H3